ԹϺ

ԹϺ’s H-Series hits 56 physical qubits that are all-to-all connected, and departs the era of classical simulation

In collaboration with JPMorgan Chase & Co., ԹϺ’s H2-1 achieved a massive uplift in an iconic demonstration

June 5, 2024

The first half of 2024 will go down as the period when we shed the last vestiges of the “wait and see” culture that has dominated the quantum computing industry. Thanks to a run of recent achievements, we have helped to lead the entire quantum computing industry into a new, post-classical era.

Today we are announcing the latest of these achievements: a major qubit count enhancement to our flagship System Model H2 quantum computer from 32 to 56 qubits. We also reveal meaningful results of work with our partner JPMorgan Chase & Co. that showcases a significant lift in performance.

But to understand the full importance of today’s announcements, it is worth recapping the succession of breakthroughs that confirm that we are entering a new era of quantum computing in which classical simulation will be infeasible.

A historic run

Between January and June 2024, ԹϺ’s pioneering teams published a succession of results that accelerate our path to universal fault-tolerant quantum computing. 

Our technical teams first presented a long-sought solution to the “wiring problem”, an engineering challenge that affects all types of quantum computers. In short, most current designs will require an impossible number of wires connected to the quantum processor to scale to large qubit numbers. Our solution allows us to scale to high qubit numbers with no issues, proving that our QCCD architecture has the potential to scale.

Next, we became the first quantum computing company in the world to hit “three 9s” two qubit gate fidelity across all qubit pairs in a production device. This level of fidelity in 2-qubit gate operations was long thought to herald the point at which error corrected quantum computing could become a reality. It has accelerated and intensified our focus on quantum error correction (QEC). Our scientists and engineers are working with our customers and partners to achieve multiple breakthroughs in QEC in the coming months, many of which will be incorporated into products such as the H-Series and our chemistry simulation platform, InQuanto™.

Following that, with our long-time partner Microsoft, we hit an error correction performance threshold that many believed was still years away. The System Model H2 became the first – and only – quantum computer in the world capable of creating and computing with highly reliable logical (error corrected) qubits. In this demonstration, the H2-1 configured with 32 physical qubits supported the creation of four highly reliable logical qubits operating at “better than break-even”. In the same demonstration, we also shared that logical circuit error rates were shown to be up to 800x lower than the corresponding physical circuit error rates. No other quantum computing company is even close to matching this achievement (despite many feverish claims in the past 12 months).

Pushing to the limits of supercomputing … and beyond

The quantum computing industry is departing the era when quantum computers could be simulated by a classical computer. Today, we are making two milestone announcements. The first is that our H2-1 processor has been upgraded to 56 trapped-ion qubits, making it impossible to classically simulate, without any loss of the market-leading fidelity, all-to-all qubit connectivity, mid-circuit measurement, qubit reuse, and feed forward.

The second is that the upgrade of H2-1 from 32 to 56 qubits makes our processor capable of challenging the world’s most powerful supercomputers. This demonstration was achieved in partnership with our long-term collaborator JPMorgan Chase & Co. and researchers from Caltech and Argonne National Lab.

Our collaboration tackled a well-known algorithm, , and measured the quality of our results with a suite of tests including the linear cross entropy benchmark (XEB) – an approach first made famous by Google in 2019 in a bid to demonstrate “quantum supremacy”. An XEB score close to 0 says your results are noisy – and do not utilize the full potential of quantum computing. In contrast, the closer an XEB score is to 1, the more your results demonstrate the power of quantum computing. The results on H2-1 are excellent, revealing, and worth exploring in a little detail. Here is the complete .

Better qubits, better results

Our results show how far quantum hardware has come since Google’s initial demonstration. They originally ran circuits on 53 superconducting qubits that were deep enough to severely frustrate high-fidelity classical simulation at the time, achieving an estimated XEB score of ~0.002. While they showed that this small value was statistically inconsistent with zero, improvements in classical algorithms and hardware have steadily increased what XEB scores are achievable by classical computers, to the point that classical computers can now achieve scores similar to Google’s on their original circuits.

Figure 1. At N=56 qubits, the H2 quantum computer achieves over 100x higher fidelity on computationally hard circuits compared to earlier superconducting experiments. This means orders of magnitude fewer shots are required for high confidence in the fidelity, resulting in comparable total runtimes

In contrast, we have been able to run circuits on all 56 qubits in H2-1 that are deep enough to challenge high-fidelity classical simulation while achieving an estimated XEB score of ~0.35. This >100x improvement implies the following: even for circuits large and complex enough to frustrate all known classical simulation methods, the H2 quantum computer produces results without making even a single error about 35% of the time. In contrast to past announcements associated with XEB experiments, 35% is a significant step towards the idealized 100% fidelity limit in which the computational advantage of quantum computers is clearly in sight.

This huge jump in quality is made possible by ԹϺ’s market-leading high fidelity and also our unique all-to-all connectivity. Our flexible connectivity, enabled by , enables us to implement circuits with much more complex geometries than the 2D geometries supported by superconducting-based quantum computers. This specific advantage means our quantum circuits become difficult to simulate classically with significantly fewer operations (or gates). These capabilities have an enormous impact on how our computational power scales as we add more qubits: since noisy quantum computers can only run a limited number of gates before returning unusable results, needing to run fewer gates ultimately translates into solving complex tasks with consistent and dependable accuracy.

This is a vitally important moment for companies and governments watching this space and deciding when to invest in quantum: these results underscore both the performance capabilities and the rapid rate of improvement of our processors, especially the System Model H2, as a prime candidate for achieving near-term value.

So what of the comparison between the H2-1 results and a classical supercomputer? 

A direct comparison can be made between the time it took H2-1 to perform RCS and the time it took a classical supercomputer. However, classical simulations of RCS can be made faster by building a larger supercomputer (or by distributing the workload across many existing supercomputers). A more robust comparison is to consider the amount of energy that must be expended to perform RCS on either H2-1 or on classical computing hardware, which ultimately controls the real cost of performing RCS. An analysis based on the most efficient known classical algorithm for RCS and the power consumption of leading supercomputers indicates that H2-1 can perform RCS at 56 qubits with an estimated 30,000x reduction in power consumption. These early results should be seen as very attractive for data center owners and supercomputing facilities looking to add quantum computers as “accelerators” for their users. 

Where we go next

Today’s milestone announcements are clear evidence that the H2-1 quantum processor can perform computational tasks with far greater efficiency than classical computers. They underpin the expectation that as our quantum computers scale beyond today’s 56 qubits to hundreds, thousands, and eventually millions of high-quality qubits, classical supercomputers will quickly fall behind. ԹϺ’s quantum computers are likely to become the device of choice as scrutiny continues to grow of the power consumption of classical computers applied to highly intensive workloads such as simulating molecules and material structures – tasks that are widely expected to be amenable to a speedup using quantum computers.

With this upgrade in our qubit count to 56, we will no longer be offering a commercial “fully encompassing” emulator – a mathematically exact simulation of our H2-1 quantum processor is now impossible, as it would take up the entire memory of the world’s best supercomputers. With 56 qubits, the only way to get exact results is to run on the actual hardware, a trend the leaders in this field have already embraced.

More generally, this work demonstrates that connectivity, fidelity, and speed are all interconnected when measuring the power of a quantum computer. Our competitive edge will persist in the long run; as we move to running more algorithms at the logical level, connectivity and fidelity will continue to play a crucial role in performance.

“We are entirely focused on the path to universal fault tolerant quantum computers. This objective has not changed, but what has changed in the past few months is clear evidence of the advances that have been made possible due to the work and the investment that has been made over many, many years. These results show that whilst the full benefits of fault tolerant quantum computers have not changed in nature, they may be reachable earlier than was originally expected, and crucially, that along the way, there will be tangible benefits to our customers in their day-to-day operations as quantum computers start to perform in ways that are not classically simulatable. We have an exciting few months ahead of us as we unveil some of the applications that will start to matter in this context with our partners across a number of sectors.”
– Ilyas Khan, Chief Product Officer

Stay tuned for results in error correction, physics, chemistry and more on our new 56-qubit processor.

About ԹϺ

ԹϺ, the world’s largest integrated quantum company, pioneers powerful quantum computers and advanced software solutions. ԹϺ’s technology drives breakthroughs in materials discovery, cybersecurity, and next-gen quantum AI. With over 500 employees, including 370+ scientists and engineers, ԹϺ leads the quantum computing revolution across continents. 

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March 4, 2026
Skinny Logic: Quantum Codes Go on a Diet

In our latest paper, we’ve taken a big step toward large scale fault-tolerant quantum computing, squeezing up to 94 error-detected qubits (and 48 error-corrected qubits) out of just 98 physical qubits, a low-fat encoding that cuts overhead to the bone. With 64 of our logical qubits, we were able to simulate quantum magnetism at a scale that can be exceedingly difficult for classical computers.

The "holy grail" of quantum computing is universal fault-tolerance: the ability to correct errors faster than they occur during any computation. To realize this, we aim to create “logical qubits,” which are groups of entangled physical qubits that share quantum information in a way that protects it. Better protection leads to lower “logical” error rate and greater ability to solve complex problems.

However, it’s never that easy. An unofficial law of physics is “there’s no such thing as a free lunch”. Creating high quality, low error-rate logical qubits often costs many physical qubits, thus reducing the size of calculations you can run, despite your new, lower-than-ever error rates.

With our , we are thrilled to announce that we have hit a key milestone on the ԹϺ roadmap: an ultra-efficient method for creating logical qubits, extracting a whopping 48 error-corrected and 64 error-detected logical qubits out of just 98 physical qubits. Our logical qubits boasted better than “break-even” fidelity, beating their physical counterparts with lower error rates on several different fronts. And still that isn’t the end of the story: we used our 64 error-detected logical qubits in a large-scale quantum magnetism simulation, laying the groundwork for future studies of exotic interactions in materials.

Stacking Wins

To get this world-leading result, we employed a neat trick: ‘nesting’ super efficient quantum error-detecting codes together to make a new, ultra-efficient error-correcting code. Dr. DeCross, a primary author on the paper, said this nesting is like “braiding together ropes made out of ropes made out of ropes”.  Physicists call this ‘code concatenation’, and you can think of it as adding layers of protection on top of each other.

To begin, we took the now-famous ‘iceberg code’, a quantum error detection code that gives an almost 1:1 ratio of physical qubits to logical qubits. The iceberg code only detects errors, however, which means that instead of actually correcting errors it lets you throw out bits where errors were detected. To make a code that could both detect and correct errors, we concatenated two iceberg codes together, giving a code that can correct small errors while still boasting a world-record 2:1 physical:logical ratio (physicists call this a “high encoding rate”).

The team then benchmarked the logical qubits, checking large system-scale operations and comparing them to their physical counterparts. This introduces a crucial hurdle to clear: oftentimes, researchers end up with logical qubits that perform *worse* than their physical counterparts. It’s critical that logical qubits actually beat physical ones, after all – that is the whole point!

Thanks to some clever circuit design and our natively high fidelities, the new logical qubits outperformed their physical counterparts in every test we performed, sometimes by a factor of 10 to 100.

Computing Logically

Of course, the whole point is to use our logical qubits for something useful, the ultimate measure of functionality. With 64 error-detected qubits, we performed a simulation of quantum magnetism; a crucial milestone that validates our roadmap.

The team took extra care to perform their simulation in 3 dimensions to best reflect the real-world (often, studies like this will only be in 1D or 2D to make them easier). Problems like this are both incredibly important for expanding our understanding of materials, but are also incredibly hard, as their complexity scales quickly. To make qubits interact as if they are in a 3D material when they are trapped in 2D inside the computer, we used our all-to-all connectivity, a feature that results from our movable qubits.

Maximizing Entanglement

Breaking the encoding rate record and performing a world-leading logical simulation wasn’t enough for the team. For their final feat, the team generated 94 error-detected logical qubits, and entangled them all in a special state called a “GHZ” state (also known as a ‘cat’ state, alluding to Schrödinger’s cat). GHZ states are often used by experts as a simple benchmark for showcasing quantum computing’s unique capacity to use entanglement across many qubits. Our best 94-logical qubit GHZ state boasted a fidelity of 94.9%, crushing its un-encoded counterpart.

Logical Qubits Are the New Normal

Taken together, these results show that we can suppress errors more effectively than ever before, proving that Helios is capable of delivering complex, high-fidelity operations that were previously thought to be years away. While the magnetism simulation was only error-detected, it showcases our ability to protect universal computations with partially fault-tolerant methods. On top of that, the team also demonstrated key error-corrected primitives on Helios at scale.

All of this has real-world implications for the quantum ecosystem: we are working to package these iceberg codes into QCorrect, an upcoming tool that will help developers automatically improve the performance of their own applications.

This is just the beginning: we are officially entering the era of large-scale logical computing. The path to fault-tolerance is no longer just theoretical—it is being built, gate by gate, on Helios.

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March 2, 2026
Hybrid quantum–HPC computing with trapped ions is here

Japan has made bold, strategic investments in both high-performance computing (HPC) and quantum technologies. As these capabilities mature, an important question arises for policymakers and research leaders: how do we move from building advanced machines to demonstrating meaningful, integrated use?

Last year, ԹϺ installed its Reimei quantum computer at a world-class facility in Japan operated by RIKEN, the country’s largest comprehensive research institution. The system was integrated with Japan’s famed supercomputer Fugaku, one of the most powerful in the world, as part of an ambitious national project commissioned by the New Energy and Industrial Technology Development Organization (NEDO), the national research and development entity under the Ministry of Economy, Trade and Industry.

Now, for the first time, a full scientific workflow has been executed across Fugaku, one of the world’s most powerful supercomputers, and Reimei, our trapped-ion quantum computer. This marks a transition from infrastructure development to practical deployment.

Quantum Biology

In this first foray into hybrid HPC-quantum computation, the team explored chemical reactions that occur inside biomolecules such as proteins. Reactions of this type are found throughout biology, from enzyme functions to drug interactions.

Simulating such reactions accurately is extremely challenging. The region where the chemical reaction occurs—the “active site”—requires very high precision, because subtle electronic effects determine the outcome. At the same time, this active site is embedded within a much larger molecular environment that must also be represented, though typically at a lower level of detail.

To address this complexity, computational chemistry has long relied on layered approaches, in which different parts of a system are treated with different methods. In our work, we extended this concept into the hybrid computing era by combining classical supercomputing with quantum computing.

Shifting the Paradigm

While the long-term goal of quantum computing is to outperform classical approaches alone, the purpose of this project was to demonstrate a fully functional hybrid system working as an end-to-end platform for real scientific applications. We believe it is not enough to develop hardware in isolation – we must also build workflows where classical and quantum resources create a whole that is greater than the parts. We believe this is a crucial step for our industry; large-scale national investments in quantum computing must ultimately show how the technology can be embedded within existing research infrastructure.

In this work, the supercomputer Fugaku handled geometry optimization and baseline electronic structure calculations. The quantum computer Reimei was used to enhance the treatment of the most difficult electronic interactions in the active site, those that are known to challenge conventional approximate methods. The entire process was coordinated through ԹϺ’s workflow system , which allows jobs to move efficiently between machines.

Hybrid Computation is Now an Operational Reality

With this infrastructure in place, we are now poised to truly leverage the power of quantum computing. In this instance, the researchers designed the algorithm to specifically exploit the strengths of both the quantum and the classical hardware.

First, the classical computer constructs an approximate description of the molecular system. Then, the quantum computer is used to model the detailed quantum mechanics that the classical computer can’t handle. Together, this improves accuracy, extending the utility of the classical system.

A Path to Hybrid Advantage

Accurate simulation of biomolecular reactions remains one of the major challenges in biochemistry. Although the present study uses simplified systems to focus on methodology, it lays the groundwork for future applications in drug design, enzyme engineering, and photoactive biological systems.

While fully fault-tolerant, large-scale quantum computers are still under development, hybrid approaches allow today’s quantum hardware to augment powerful classical systems, such as Fugaku, to explore meaningful applications. As quantum technology matures, the same workflows can scale accordingly.

High-performance computing centers worldwide are actively exploring how quantum devices might integrate into their ecosystems. By demonstrating coordinated job scheduling, direct hardware access, and workflow orchestration across heterogeneous architectures, this work offers a concrete example of how such integration can be achieved.

As quantum hardware matures, we believe the algorithms and workflows developed here can be extended to increasingly realistic and industrially relevant problems. For Japan’s research ecosystem, this first application milestone signals that hybrid quantum–supercomputing is moving from ambition to implementation.

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December 11, 2025
Automated Quantum Algorithm Discovery for Quantum Chemistry

ܳٳǰ:
ԹϺ (alphabetical order): Eric Brunner, Steve Clark, Fabian Finger, Gabriel Greene-Diniz, Pranav Kalidindi, Alexander Koziell-Pipe, David Zsolt Manrique, Konstantinos Meichanetzidis, Frederic Rapp
Hiverge (alphabetical order): Alhussein Fawzi, Hamza Fawzi, Kerry He, Bernardino Romera Paredes, Kante Yin

What if every quantum computing researcher had an army of students to help them write efficient quantum algorithms? Large Language Models are starting to serve as such a resource.

ԹϺ’s processors offer world-leading fidelity, and recent experiments show that they have surpassed the limits of classical simulation for certain computational tasks, such as simulating materials. However, access to quantum processors is limited and can be costly. It is therefore of paramount importance to optimise quantum resources and write efficient quantum software. Designing efficient algorithms is a challenging task, especially for quantum algorithms: dealing with superpositions, entanglement, and interference can be counterintuitive.

To this end, our joint team used AI platform for automated algorithm discovery, the Hive, to probe the limits of what can be done in quantum chemistry. The Hive generates optimised algorithms tailored to a given problem, expressed in a familiar programming language, like Python. Thus, the Hive’s outputs allow for increased interpretability, enabling domain experts to potentially learn novel techniques from the AI-discovered solutions. Such AI-assisted workflows lower the barrier of entry for non-domain experts, as an initial sketch of an algorithmic idea suffices to achieve state-of-the-art solutions.

In this initial proof-of-concept study, we demonstrate the advantage of AI-driven algorithmic discovery of efficient quantum heuristics in the context of quantum chemistry, in particular the electronic structure problem. Our early explorations show that the Hive can start from a naïve and simple problem statement and evolve a highly optimised quantum algorithm that solves the problem, reaching chemical precision for a collection of molecules. Our high-level workflow is shown in Figure 1. Specifically, the quantum algorithm generated by the Hive achieves a reduction in the quantum resources required by orders of magnitude compared to current state-of-the-art quantum algorithms. This promising result may enable the implementation of quantum algorithms on near-term hardware that was previously thought impossible due to current resource constraints.

Figure 1: Workflow: A scientist prompts Hiverge's platform, the Hive, with the molecule of interest and a sketch of a quantum algorithm. The goal of the quantum algorithm is to find the ground state energy of the molecule. The Hive evolves the sketch into an efficient version that solves the problem.
The Electronic Structure Problem in Quantum Chemistry

The electronic structure problem is central to quantum chemistry. The goal is to prepare the ground state (the lowest energy state) of a molecule and compute the corresponding energy of that state to chemical precision or beyond. Classically, this is an exponentially hard problem. In particular, classical treatments tend to fall short when there are strong quantum effects in the molecule, and this is where quantum computers may be advantageous.

The paradigm of variational quantum algorithms is motivated by near-term quantum hardware. One starts with a relatively easy-to-prepare initial state. Then, the main part of the algorithm consists of a sequence of parameterised operators representing chemically meaningful actions, such as manipulating electron occupations in the molecular orbitals. These are implemented in terms of parameterised quantum gates. Finally, the energy of the state is measured via the molecule’s energy operator, the “Hamiltonian”, by executing the circuit on a quantum computer and measuring all the qubits on which the circuit is implemented. Taking many measurements, or “shots”, the energy is estimated to the desired precision. The ground state energy is found by iteratively optimising the parameters of the quantum circuit until the energy converges to a minimum value. The general form of such a variational quantum algorithm is illustrated in Figure 2.

Figure 2: A variational quantum algorithm is defined by a function select_next_operator that iteratively constructs a parameterised quantum circuit as a sequence of operators [O1(θ1),O2(θ2),O3(θ3), ...], and a function update_parameters that optimises its parameters; these functions update the quantum circuit and refine it to its final form that prepares the ground state. The Hive evolves sophisticated versions of these functions starting from trivial versions, written in a familiar programming language, producing a novel, efficient variational quantum algorithm that solves the problem.

The main challenge in these frameworks is to design an appropriate quantum circuit architecture, i.e. find an efficient sequence of operators, and an efficient optimisation strategy for its parameters. It is important to minimise the number of quantum operations in any given circuit, as each operation is inherently noisy and the algorithm’s output degrades exponentially. Another important quantum resource to be minimised is the total number of circuits that need to be evaluated to compute the energy values during the optimisation of the circuit parameters, which is time-consuming.

To meet these challenges, we task the Hive with designing a variational quantum algorithm to solve the ground state problem, following the workflow shown in Figure 1. The Hive is a distributed evolutionary process that evolves programs. It uses Large Language Models to generate mutations in the form of edits to an entire codebase. This genetic process selects the fittest programs according to how well they solve a given problem. In our case, the role of the quantum computer is to compute the fitness, i.e., the ground state energy. Importantly, the Hive operates at the level of a programming language; it readily imports and uses all known libraries that a human researcher would use, including ԹϺ’s quantum chemistry platform, InQuanto. In addition, the Hive can accept instructions and requests in natural language, increasing its flexibility. For example, we encouraged it to seek parameter optimisation strategies that avoid estimating gradients, as this incurs significant overhead in terms of circuit evaluations.  Intuitively, the interaction between a human scientist and the Hive is analogous to a supervisor and a group of eager and capable students: the supervisor provides guidance at a high level, and the students collaborate and flesh out the general idea to produce a working solution that the supervisor can then inspect.

We find that from an extremely basic starting point, consisting of a skeleton for a variational quantum algorithm, the Hive can autonomously assemble a bespoke variational quantum algorithm, which we call Hive-ADAPT. Specifically, the Hive evolves heuristic functions that construct a circuit as a sequence of quantum operators and optimise its parameters. Remarkably, the Hive converged on a structure resembling the current state-of-the-art, ADAPT-VQE. Crucially, however, Hive-ADAPT substantially outperforms this baseline, delivering significant improvements in chemical precision while reducing quantum resource requirements.

Figure 3: (Top): The measured ground state energy of the molecule in Hartree (Ha) as a function of the bond length in Angstrom (Å), i.e. the length of the O-H and Be-H bonds in H2O and BeH2, respectively. Both ADAPT-VQE and Hive-ADAPT recover the energy curve. (Bottom): The difference between the energy estimated by the quantum algorithms and the reference value computed with the exact FCI method. Hive-ADAPT achieves chemical precision for more bond lengths than ADAPT-VQE (energy below dashed flat lines). Hive-ADAPT was evolved by the Hive to solve a particular set of bond lengths (red circles), and we observe that the same algorithm can also solve the problem on other bond lengths (green circles), showing generalisation over bond lengths.

A molecule’s ground state energy varies with the distances between its atoms, called the “bond length”. For example, for the molecule H2O, the bond length refers to the length of the O-H bond. The Hive was tasked with developing an algorithm for a small set of bond lengths and reaching chemical precision, defined as within 1.6e-3 Hartree (Ha) of the ground state energy computed with the exact Full Configuration Interaction (FCI) algorithm. As we show in Figure 3, remarkably, Hive-ADAPT achieves chemical precision for more bond lengths than ADAPT-VQE. Furthermore, Hive-ADAPT also reaches chemical precision for other “unseen” bond lengths, showcasing the generalisation ability of the evolved quantum algorithm. Our results were obtained from classical simulations of the quantum algorithms, where we used NVIDIA CUDA-Q to leverage the parallelism enabled by GPUs. Further, relative to ADAPT-VQE, Hive-ADAPT exhibits one to two orders of magnitude reduction in quantum resources, such as the number of circuit evaluations and the number of operators used to construct circuits, which is crucial for practical implementations on actual near-term processors.

For molecules such as BeH2 at large Be-H bond lengths, a complex initial state is required for the algorithm to be able to reach the ground state using the available operators. Even in these cases, by leveraging an efficient state preparation scheme implemented in InQuanto, the Hive evolved a dedicated strategy for the preparation of such a complex initial state, given a set of basic operators to achieve the desired chemical precision.

To validate Hive-ADAPT under realistic conditions, we employed ԹϺ’s H2 Emulator, which provides a faithful classical simulator of the H2 quantum computer, characterised by a 1.05e-3 two-qubit gate error rate. Leveraging the Hive's inherent flexibility, we adapted the optimisation strategy to explicitly penalise the number of two-qubit gates—the dominant noise source on near-term hardware—by redefining the fitness function. This constraint guided the Hive to discover a noise-aware algorithm capable of constructing hardware-efficient circuits. We subsequently executed the specific circuit generated by this algorithm for the LiH molecule at a bond length of 1.5 Å with the Partition Measurement Symmetry Verification (PMSV) error mitigation procedure. The resulting energy of -7.8767 ± 0.0031 Ha, obtained using 10,000 shots per circuit with a discard rate below 10% in the PMSV error mitigation procedure, is close to the target FCI energy of -7.8824 Ha and demonstrates the Hive's ability to successfully tailor algorithms that balance theoretical accuracy with the rigorous constraints of hardware noise and approach chemical precision as much as possible with current quantum technology.

For illustration purposes, we show an example of an elaborate code snippet evolved by the Hive starting from a trivial version:

ԹϺ’s in-house quantum chemistry expert, Dr. David Zsolt Manrique, commented,

“I found it amazing that the Hive converged to a domain-expert level idea. By inspecting the code, we see it has identified the well-known perturbative method, ‘MP2’, as a useful guide; not only for setting the initial circuit parameters, but also for ordering excitations efficiently. Further, it systematically and laboriously fine-tuned those MP2-inspired heuristics over many iterations in a way that would be difficult for a human expert to do by hand. It demonstrated an impressive combination of domain expertise and automated machinery that would be useful in exploring novel quantum chemistry methods.”
Looking to the Future

In this initial proof-of-concept collaborative study between ԹϺ and Hiverge, we demonstrate that AI-driven algorithm discovery can generate efficient quantum heuristics. Specifically, we found a great reduction in quantum resources, which is impactful for quantum algorithmic primitives that are frequently reused. Importantly, this approach is highly flexible; it can accommodate the optimisation of any desired quantum resource, from circuit evaluations to the number of operations in a given circuit. This work opens a path toward fully automated pipelines capable of developing problem-specific quantum algorithms optimised for NISQ as well as future hardware.

An important question for further investigation regards transferability and generalisation of a discovered quantum solution to other molecules, going beyond the generalisation over bond lengths of the same molecule that we have already observed. Evidently, this approach can be applied to improving any other near-term quantum algorithm for a range of applications from optimisation to quantum simulation.

We have already demonstrated an error-corrected implementation of quantum phase estimation on quantum hardware, and an AI-driven approach promises further hardware-tailored improvements and optimal use of quantum resources. Beyond NISQ, we envision that AI-assisted algorithm discovery will be a fruitful endeavour in the fault-tolerant regime, as well, where high-level quantum algorithmic primitives (quantum fourier transform, amplitude amplification, quantum signal processing, etc.) are to be combined optimally to achieve computational advantage for certain problems.

Notably, we’ve entered an era where quantum algorithms can be written in high-level programming languages, like ԹϺ’s , and approaches that integrate Large Language Models directly benefit. Automated algorithm discovery is promising for improving routines relevant to the full quantum stack, for example, in low-level quantum control or in quantum error correction.

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